diethyl 2-[2-[methyl-(phenylmethyl)amino]ethyl]-2-(2-methylsulfanylethyl)propanedioate

Systemtic Name: diethyl 2-[2-[methyl-(phenylmethyl)amino]ethyl]-2-(2-methylsulfanylethyl)propanedioate Openeye Name: diethyl 2-[2-[benzyl(methyl)amino]ethyl]-2-(2-methylsulfanylethyl)propanedioate CAS Name: 2-[2-[methyl-(phenylmethyl)amino]ethyl]-2-[2-(methylthio)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[benzyl(methyl)amino]ethyl]-2-(2-methylsulfanylethyl)propanedioate Traditional Name: 2-[2-[benzyl(methyl)amino]ethyl]-2-[2-(methylthio)ethyl]malonic acid diethyl ester Formula: C20H31NO4S MolecularWeight: 381.52944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN(C)CC1=CC=CC=C1)(CCSC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCN(C)CC1=CC=CC=C1)(CCSC)C(=O)OCC

InChI

InChI=1S/C20H31NO4S/c1-5-24-18(22)20(13-15-26-4,19(23)25-6-2)12-14-21(3)16-17-10-8-7-9-11-17/h7-11H,5-6,12-16H2,1-4H3